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Fix Issue #22 #33

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Fix Issue #22 #33

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RMeli
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@RMeli RMeli commented Mar 1, 2022

Fix #22

@@ -768,7 +765,9 @@ def main():
parser.add_argument('-o', '--output-format',
action="store",
type=str,
help="Output format [smiles,sdf] (default=sdf)")
default="sdf",
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Not sure what the intended default behaviour is since the previous options where pointing in opposite directions... SDF or SMILES?

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RMeli commented Mar 13, 2023

Closing as stale (and because this is now integrated into RDKit).

@RMeli RMeli closed this Mar 13, 2023
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--sdf argument
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